Moment based weighted residual method¡ªNew numerical tool for a nonlinear multicomponent chromatographic general rate model

详细信息    查看全文

• 作者：Zheng Liu^a ; ^{zheng.liu@aalto.fi} ; Jonas Roininen^b ; Iiro Pulkkinen^a ; Tuomo Sainio^c ; Ville Alopaeus^a
• 关键词：Chromatographic general rate model ; High resolution numerical methods ; Moment transformation ; Polynomial approximation
• 刊名：Computers and Chemical Engineering
• 出版年：2013
• 出版时间：11 June, 2013
• 年：2013
• 卷：53
• 期：Complete
• 页码：153-163
• 全文大小：577 K

文摘

A new numerical method is proposed to solve a nonlinear general rate model, frequently used to describe chromatographic multicomponent separations. The method is based on minimization of errors in chromatographic column profile moments, and it belongs to the family of weighted residual methods. Compared to most traditional weighted residual methods, the present formulation has some clear advantages. Firstly, it is inherently mass conserving. Secondly, the separation characteristic values of the effluent curve (retention time, physical dispersion and skewness) are predicted with good accuracy. Thirdly, the boundary conditions are treated naturally as source terms. The method is inherently of high order, so it gives high accuracy with a relatively low number of variables. This is a remarkable benefit especially for model parameter fitting or process optimization, when the model has to be solved repeatedly.